RefChem:1091392
TL;DR: RefChem:1091392 (CAS 117651-74-8) is a chemical compound with molecular formula C20H27ClN4O and molecular weight 374.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-adamantyl)-2-(2-imino-3-methylbenzimidazol-1-yl)acetamide;hydrochloride
Also Known As: 1H-Benzimidazole-1-acetamide, 2,3-dihydro-2-imino-3-methyl-N-tricyclo(3.3.1.1(sup 3,7))dec-2-yl-, monohydrochloride, N-(2-adamantyl)-2-(2-imino-3-methylbenzimidazol-1-yl)acetamide;hydrochloride, N-(Adamantan-2-yl)-2-(2-imino-3-methyl-2,3-dihydro-1H-benzimidazol-1-yl)ethanimidic acid--hydrogen chloride (1/1), N-(2-adamantyl)-2-(2-imino-3-methyl-benzoimidazol-1-yl)acetamide Hydrochloride, N-(2-adamantyl)-2-(2-imino-3-methylbenzimidazol-1-yl)acetamide hydrochloride
| Molecular Formula | C20H27ClN4O |
|---|---|
| Molecular Weight | 374.19 g/mol |
| LogP | 2.82197 |
| Topological Polar Surface Area | 62.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.18735 |
| Heavy Atoms | 26 |
| Complexity | 870.8385 |
Chemical Identifiers
| CAS Number | 117651-74-8 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N(C1=N)CC(=O)NC3C4CC5CC(C4)CC3C5.Cl |
Product Overview
RefChem:1091392 (CAS 117651-74-8), with molecular formula C20H27ClN4O and molecular weight 374.19 g/mol. IUPAC: N-(2-adamantyl)-2-(2-imino-3-methylbenzimidazol-1-yl)acetamide;hydrochloride.
Chemical Property Profile of RefChem:1091392
Property Insights of RefChem:1091392
The XLogP value of 2.82197 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1091392. The TPSA of 62.81 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1091392. Following Lipinski's Rule of Five, RefChem:1091392 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1091392?
The CAS number of RefChem:1091392 is 117651-74-8.
What is the molecular formula of RefChem:1091392?
The molecular formula of RefChem:1091392 is C20H27ClN4O.
What is the molecular weight of RefChem:1091392?
The molecular weight of RefChem:1091392 is 374.19 g/mol.
Where can I buy RefChem:1091392?
You can request a quote for RefChem:1091392 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1091392?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1091392 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.